SCHEMBL9976973

SCHEMBL9976973

c1ccc(-c2c3c(c(-c4ccccc4)c4ccccc24)-c2ccc(-c4cccc(-n5c(-c6ccccc6)nc6ccccc65)c4)c4cccc-3c24)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 2/20 0.46
▸ ESR2 Q92731 2/20 0.46
▸ GAA P10253 2/20 0.45
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ HDAC1 Q13547 2/20 0.42
▸ HDAC8 Q9BY41 2/20 0.42
▸ HDAC6 Q9UBN7 2/20 0.42
▸ RECQL P46063 1/20 0.41
▸ ALDH1A1 P00352 3/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ LMNA P02545 1/20 0.39
▸ PDE10A Q9Y233 1/20 0.39
▸ GRIA1 P42261 1/20 0.38
▸ CACNG8 Q8WXS5 1/20 0.38
▸ CACNG2 Q9Y698 1/20 0.38
▸ MAPT P10636 3/20 0.38
▸ MAPK1 P28482 1/20 0.37
▸ HTT P42858 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9976971 0.93 HDAC1 (0.47) ESR1ESR2GAAMEN1KMT2A
SCHEMBL9976977 0.92 ESR1 (0.50) ESR1ESR2GAAMEN1KMT2A
SCHEMBL9976976 0.92 ESR1 (0.46) ESR1ESR2GAAMEN1KMT2A
SCHEMBL9611839 0.91 ESR1 (0.50) ESR1ESR2GAAMEN1KMT2A
SCHEMBL9976975 0.90 ESR1 (0.53) ESR1ESR2GAAMEN1KMT2A
SCHEMBL9976983 0.89 ESR1 (0.52) ESR1ESR2GAAMEN1KMT2A
SCHEMBL9611870 0.89 ESR1 (0.51) ESR1ESR2GAAMEN1KMT2A
SCHEMBL22707453 0.89 ESR1 (0.50) ESR1ESR2GAAMEN1KMT2A
SCHEMBL25643088 0.87 HDAC1 (0.42) ESR1ESR2GAAMEN1KMT2A
SCHEMBL26344161 0.87 ESR1 (0.46) ESR1ESR2GAAMEN1KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2525425-B1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO (JP) 2014-10-15 — — EP disclosed
US-8803420-B2 Organic electroluminescence device IDEMITSU KOSAN CO., LTD. (JP) 2014-08-12 — — US disclosed
US-8803420-B2 Organic electroluminescence device IDEMITSU KOSAN CO., LTD. (JP) 2014-08-12 — — US disclosed
US-20120153268-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2012-06-21 — — US disclosed
US-20120153268-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2012-06-21 — — US disclosed
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